@MOLECULE (z)-3-methyl-2-pentene 18 17 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 C -0.6780 0.9105 0.0509 C.3 1 UNL1 -0.2669 2 C 0.0581 -0.3969 0.0098 C.2 1 UNL1 0.0261 3 C -2.2011 0.8091 -0.0390 C.3 1 UNL1 -0.4313 4 C -0.7491 -1.6545 0.0085 C.3 1 UNL1 -0.4487 5 C 1.3977 -0.4608 -0.0167 C.2 1 UNL1 -0.2175 6 C 2.3210 0.7071 -0.0113 C.3 1 UNL1 -0.4330 7 H 1.9096 -1.4221 -0.0441 H 1 UNL1 0.1440 8 H -0.3135 1.5581 -0.7768 H 1 UNL1 0.1473 9 H -0.4056 1.4443 0.9881 H 1 UNL1 0.1476 10 H -2.6604 1.8042 -0.0152 H 1 UNL1 0.1397 11 H -2.5178 0.3244 -0.9693 H 1 UNL1 0.1441 12 H -2.6185 0.2359 0.7961 H 1 UNL1 0.1439 13 H -0.1255 -2.5580 -0.0076 H 1 UNL1 0.1482 14 H -1.3846 -1.7186 0.9031 H 1 UNL1 0.1550 15 H -1.4076 -1.7034 -0.8702 H 1 UNL1 0.1555 16 H 2.9934 0.6701 0.8587 H 1 UNL1 0.1507 17 H 2.9531 0.7096 -0.9118 H 1 UNL1 0.1507 18 H 1.8064 1.6745 0.0230 H 1 UNL1 0.1446 @BOND 1 11 3 1 2 17 6 1 3 15 4 1 4 8 1 1 5 7 5 1 6 3 10 1 7 3 1 1 8 3 12 1 9 5 6 1 10 5 2 2 11 6 18 1 12 6 16 1 13 13 4 1 14 4 2 1 15 4 14 1 16 2 1 1 17 1 9 1